Information card for entry 2207329

Structure parameters

• Chemical name: Di-μ-furan-2-selenolato-bis[(furan-2-selenolato)(triphenylphosphine)palladium]
• Formula: C52 H42 O4 P2 Pd2 Se4
• Calculated formula: C52 H42 O4 P2 Pd2 Se4
• SMILES: o1c(ccc1)[Se][Pd]1([Se](c2ccco2)[Pd]([P](c2ccccc2)(c2ccccc2)c2ccccc2)([Se]c2occc2)[Se]1c1occc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Di-μ-furan-2-selenolato-bis[(furan-2-selenolato)(triphenylphosphine)palladium(II)]
• Authors of publication: Wagner, Andreas; Hannu-Kuure, Milja S.; Oilunkaniemi, Raija; Laitinen, Risto S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: m2198 - m2200
• a: 13.045 ± 0.003 Å
• b: 16.394 ± 0.003 Å
• c: 12.233 ± 0.002 Å
• α: 90°
• β: 110.85 ± 0.03°
• γ: 90°
• Cell volume: 2444.8 ± 1 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0538
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.0945
• Weighted residual factors for all reflections included in the refinement: 0.1018
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes